General Information of the Compound
| Compound ID |
CP0902577
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| Compound Name |
((4-(5-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)-2-methylbenzamido)methyl)phosphonic acid
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| Structure |
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| Formula |
C26H37N4O9P
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| Molecular Weight |
580.575
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2ccc(C(=O)NCP(=O)(O)O)c(C)c2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C26H37N4O9P/c1-4-6-7-8-20(21(5-2)30(35)16-31)25(33)27-14-28-26(34)23-12-11-22(39-23)18-9-10-19(17(3)13-18)24(32)29-15-40(36,37)38/h9-13,16,20-21,35H,4-8,14-15H2,1-3H3,(H,27,33)(H,28,34)(H,29,32)(H2,36,37,38)/t20-,21-/m1/s1
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| InChIKey |
FJXMXQDWRPCUIL-NHCUHLMSSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT04609, Tolloid-like protein 1
Protein ID: PT06770, Tolloid-like protein 2